4-(difluoromethyl)-6-imidazol-1-yl-2-methylpyrimidine

C9H8F2N4 — CID 166480985

IUPAC4-(difluoromethyl)-6-imidazol-1-yl-2-methylpyrimidine
SMILESCc1nc(C(F)F)cc(-n2ccnc2)n1
InChIInChI=1S/C9H8F2N4/c1-6-13-7(9(10)11)4-8(14-6)15-3-2-12-5-15/h2-5,9H,1H3
InChIKeyMOHASTSYHMMOGS-UHFFFAOYSA-N
MW210.19 g/mol
LogP1.91
Rot. Bonds2

About 4-(difluoromethyl)-6-imidazol-1-yl-2-methylpyrimidine

4-(difluoromethyl)-6-imidazol-1-yl-2-methylpyrimidine (PubChem CID 166480985) has the molecular formula C9H8F2N4 and a molecular weight of 210.19 g/mol. Its IUPAC name is 4-(difluoromethyl)-6-imidazol-1-yl-2-methylpyrimidine.

Molecular Properties

Compound Name4-(difluoromethyl)-6-imidazol-1-yl-2-methylpyrimidine
PubChem CID166480985
Molecular FormulaC9H8F2N4
Molecular Weight210.19 g/mol
Exact Mass210.07
IUPAC Name4-(difluoromethyl)-6-imidazol-1-yl-2-methylpyrimidine
SMILESCc1nc(C(F)F)cc(-n2ccnc2)n1
InChIInChI=1S/C9H8F2N4/c1-6-13-7(9(10)11)4-8(14-6)15-3-2-12-5-15/h2-5,9H,1H3
InChIKeyMOHASTSYHMMOGS-UHFFFAOYSA-N
XLogP1.91
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.19
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-(difluoromethyl)-6-imidazol-1-yl-2-methylpyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethyl)-6-imidazol-1-yl-2-methylpyrimidine?
The IUPAC name of 4-(difluoromethyl)-6-imidazol-1-yl-2-methylpyrimidine (CID 166480985) is 4-(difluoromethyl)-6-imidazol-1-yl-2-methylpyrimidine.
What is the SMILES notation for 4-(difluoromethyl)-6-imidazol-1-yl-2-methylpyrimidine?
The canonical SMILES for 4-(difluoromethyl)-6-imidazol-1-yl-2-methylpyrimidine is Cc1nc(C(F)F)cc(-n2ccnc2)n1.
What is the InChIKey of 4-(difluoromethyl)-6-imidazol-1-yl-2-methylpyrimidine?
The InChIKey is MOHASTSYHMMOGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F2N4/c1-6-13-7(9(10)11)4-8(14-6)15-3-2-12-5-15/h2-5,9H,1H3.
What are the key properties of 4-(difluoromethyl)-6-imidazol-1-yl-2-methylpyrimidine?
4-(difluoromethyl)-6-imidazol-1-yl-2-methylpyrimidine has a molecular weight of 210.19 g/mol, XLogP of 1.91, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethyl)-6-imidazol-1-yl-2-methylpyrimidine is sourced from PubChem (CID 166480985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).